2-[4-(4-fluorophenyl)-2-methyl-1-oxidanylidene-isoquinolin-3-yl]ethanoic acid

Systemtic Name: 2-[4-(4-fluorophenyl)-2-methyl-1-oxidanylidene-isoquinolin-3-yl]ethanoic acid Openeye Name: 2-[4-(4-fluorophenyl)-2-methyl-1-oxo-3-isoquinolyl]acetic acid CAS Name: 2-[4-(4-fluorophenyl)-2-methyl-1-oxo-3-isoquinolinyl]acetic acid IUPAC Name: 2-[4-(4-fluorophenyl)-2-methyl-1-oxoisoquinolin-3-yl]acetic acid Traditional Name: 2-[4-(4-fluorophenyl)-1-keto-2-methyl-3-isoquinolyl]acetic acid Formula: C18H14FNO3 MolecularWeight: 311.307063

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=C(C=C3)F)CC(=O)O

Isomeric SMILES

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=C(C=C3)F)CC(=O)O

InChI

InChI=1S/C18H14FNO3/c1-20-15(10-16(21)22)17(11-6-8-12(19)9-7-11)13-4-2-3-5-14(13)18(20)23/h2-9H,10H2,1H3,(H,21,22)